![isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate structure](/static/products/4452/445232-86-0.webp)
isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate
TL;DR: isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate (CAS 445232-86-0) is a chemical compound with molecular formula C21H20FNO3S2 and molecular weight 417.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-(4-fluorophenyl)-5-methyl-2-[(5-methylthiophene-2-carbonyl)amino]thiophene-3-carboxylate
Also Known As: isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate, propan-2-yl 4-(4-fluorophenyl)-5-methyl-2-[(5-methylthiophene-2-carbonyl)amino]thiophene-3-carboxylate, isopropyl 4-(4-fluorophenyl)-5-methyl-2-(5-methylthiophene-2-carboxamido)thiophene-3-carboxylate, methylethyl 4-(4-fluorophenyl)-5-methyl-2-[(5-methyl(2-thienyl))carbonylamino] thiophene-3-carboxylate, propan-2-yl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methylthiophen-2-yl)carbonyl]amino}thiophene-3-carboxylate
| Molecular Formula | C21H20FNO3S2 |
|---|---|
| Molecular Weight | 417.09 g/mol |
| LogP | 6.05004 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.08685 |
| Heavy Atoms | 28 |
| Complexity | 1018.95276 |
Chemical Identifiers
| CAS Number | 445232-86-0 |
|---|---|
| SMILES | CC1=CC=C(S1)C(=O)NC2=C(C(=C(S2)C)C3=CC=C(C=C3)F)C(=O)OC(C)C |
Product Overview
isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate (CAS 445232-86-0), with molecular formula C21H20FNO3S2 and molecular weight 417.09 g/mol. IUPAC: propan-2-yl 4-(4-fluorophenyl)-5-methyl-2-[(5-methylthiophene-2-carbonyl)amino]thiophene-3-carboxylate.
Chemical Property Profile of isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate
Property Insights of isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate
The XLogP value of 6.05004 indicates that isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate?
The CAS number of isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate is 445232-86-0.
What is the molecular formula of isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate?
The molecular formula of isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate is C21H20FNO3S2.
What is the molecular weight of isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate?
The molecular weight of isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate is 417.09 g/mol.
Where can I buy isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate?
You can request a quote for isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for isopropyl 4-(4-fluorophenyl)-5-methyl-2-{[(5-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.